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Substance Name: Pyridine, 3-(4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)-
RN: 141078-96-8
InChIKey: LKMDBKDTZIUSMX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H18-N4-O

Molecular Weight

  • 342.4002
 
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Names and Synonyms

Synonyms

  • 3-(4-(4-Methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)pyridine
  • BRN 5451655

Systematic Name

  • Pyridine, 3-(4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)-

Registry Numbers

CAS Registry Number

  • 141078-96-8

System Generated Number

  • 0141078968

Structure Descriptors

InChI

1S/C21H18N4O/c1-16-9-11-18(12-10-16)25-20(15-26-19-7-3-2-4-8-19)23-24-21(25)17-6-5-13-22-14-17/h2-14H,15H2,1H3

InChIKey

LKMDBKDTZIUSMX-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)n2c(nnc2c3cccnc3)COc4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 31, Pg. 289, 1992.